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2-(3-benzyl-4-methylsulfanylquinolin-2-ylmethyl)-acrylic acid ethyl ester
SpectraBase Compound ID IgjJBQzBzV6
InChI InChI=1S/C23H23NO2S/c1-4-26-23(25)16(2)14-21-19(15-17-10-6-5-7-11-17)22(27-3)18-12-8-9-13-20(18)24-21/h5-13H,2,4,14-15H2,1,3H3
InChIKey MUZJVFJFIFIHEF-UHFFFAOYSA-N
Mol Weight 377.5 g/mol
Molecular Formula C23H23NO2S
Exact Mass 377.14495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 46fxNSZ19A0
Name 2-(3-benzyl-4-methylsulfanylquinolin-2-ylmethyl)-acrylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H23NO2S
InChI InChI=1S/C23H23NO2S/c1-4-26-23(25)16(2)14-21-19(15-17-10-6-5-7-11-17)22(27-3)18-12-8-9-13-20(18)24-21/h5-13H,2,4,14-15H2,1,3H3
InChIKey MUZJVFJFIFIHEF-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol702494k
Molecular Weight 377.502 g/mol
SMILES c1(c(CC(=C)C(=O)OCC)nc2ccccc2c1SC)Cc1ccccc1
SPLASH splash10-0006-0190000000-057f3d06c31a1f6adcd5
Source of Spectrum A1-9-5525/SMS11-13
Synonyms Ethyl 2-((3-benzyl-4-(methylthio)quinolin-2-yl)methyl)acrylate
Wiley ID 1758889